5LXD
Crystal structure of DYRK2 in complex with EHT 1610 (compound 2)
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | DIAMOND BEAMLINE I04-1 |
Synchrotron site | Diamond |
Beamline | I04-1 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2012-12-19 |
Detector | DECTRIS PILATUS 2M |
Wavelength(s) | 0.9200 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 66.240, 130.000, 136.330 |
Unit cell angles | 90.00, 90.40, 90.00 |
Refinement procedure
Resolution | 47.040 - 2.580 |
R-factor | 0.19982 |
Rwork | 0.197 |
R-free | 0.25303 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.011 |
RMSD bond angle | 1.179 |
Data reduction software | iMOSFLM |
Data scaling software | SCALA |
Phasing software | PHASER |
Refinement software | REFMAC (5.7.0032) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 47.040 | 2.720 |
High resolution limit [Å] | 2.580 | 2.580 |
Rmerge | 0.091 | 0.649 |
Number of reflections | 35477 | |
<I/σ(I)> | 9.1 | 2 |
Completeness [%] | 97.8 | 99.4 |
Redundancy | 3.4 | 3.5 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 7.5 | 277.15 | 1.5 M Li2SO4 and 0.1 M HEPES, pH 7.5 |